CID 82831

Molybdenum trisulfide

Structural Information

Molecular Formula
MoS3
SMILES
S=[Mo](=S)=S
InChI
InChI=1S/Mo.3S
InChIKey
TVWWSIKTCILRBF-UHFFFAOYSA-N
Compound name
tris(sulfanylidene)molybdenum
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2239
Patents

193.82161 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.82889 127.9
[M+Na]+ 216.81083 136.5
[M-H]- 192.81433 127.6
[M+NH4]+ 211.85543 149.6
[M+K]+ 232.78477 131.0
[M+H-H2O]+ 176.81887 122.6
[M+HCOO]- 238.81981 133.6
[M+CH3COO]- 252.83546 169.2
[M+Na-2H]- 214.79628 126.4
[M]+ 193.82106 126.4
[M]- 193.82216 126.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe